EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C26H21N3O3S |
| Net Charge | 0 |
| Average Mass | 455.539 |
| Monoisotopic Mass | 455.13036 |
| SMILES | COc1ccccc1NC(=O)c1sc2ncn(Cc3cccc4ccccc34)c(=O)c2c1C |
| InChI | InChI=1S/C26H21N3O3S/c1-16-22-25(33-23(16)24(30)28-20-12-5-6-13-21(20)32-2)27-15-29(26(22)31)14-18-10-7-9-17-8-3-4-11-19(17)18/h3-13,15H,14H2,1-2H3,(H,28,30) |
| InChIKey | QYAGGNKNMUBSOE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-methoxyphenyl)-5-methyl-3-(1-naphthalenylmethyl)-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide (CHEBI:121630) is a aromatic amide (CHEBI:62733) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33073 | LINCS |